Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4k9s_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 3.A N PHE 289.A O no hydrogen 2.777 N/A TYR 5.A N THR 288.A O no hydrogen 2.951 N/A GLY 6.A N ASP 4.A OD1 no hydrogen 2.968 N/A ALA 8.A N ASP 4.A OD2 no hydrogen 2.792 N/A ALA 10.A N ASN 7.A O no hydrogen 3.240 N/A SER 11.A N ALA 8.A O no hydrogen 2.996 N/A SER 11.A OG ALA 8.A O no hydrogen 2.466 N/A LYS 15.A N PRO 12.A O no hydrogen 2.986 N/A LYS 15.A NZ THR 26.A O no hydrogen 2.658 N/A LYS 15.A NZ ASP 209.A OD1 no hydrogen 3.236 N/A LYS 15.A NZ ASP 209.A OD2 no hydrogen 2.863 N/A LEU 16.A N TRP 13.A O no hydrogen 2.923 N/A SER 18.A N LYS 14.A O no hydrogen 3.244 N/A SER 18.A OG LYS 14.A O no hydrogen 3.043 N/A VAL 19.A N LYS 15.A O no hydrogen 2.918 N/A ALA 20.A N LEU 16.A O no hydrogen 2.871 N/A GLN 21.A N GLN 17.A O no hydrogen 3.072 N/A GLY 22.A N VAL 19.A O no hydrogen 2.868 N/A SER 23.A N SER 18.A O no hydrogen 2.941 N/A SER 23.A OG SER 18.A O no hydrogen 3.068 N/A SER 23.A OG GLU 25.A OE1 no hydrogen 3.223 N/A GLU 25.A N SER 23.A OG no hydrogen 3.420 N/A PHE 27.A N GLY 178.A O no hydrogen 2.730 N/A ARG 28.A N ASP 209.A OD2 no hydrogen 2.891 N/A ARG 28.A NE GLU 173.A OE2 no hydrogen 2.547 N/A ILE 29.A N THR 180.A O no hydrogen 2.856 N/A LEU 30.A N LEU 210.A O no hydrogen 3.088 N/A GLN 31.A N SER 182.A O no hydrogen 2.918 N/A GLN 31.A NE2 THR 37.A OG1 no hydrogen 3.094 N/A ILE 32.A N ILE 212.A O no hydrogen 2.807 N/A ASP 34.A N SER 214.A O no hydrogen 3.175 N/A HIS 36.A N ASP 34.A OD1 no hydrogen 3.263 N/A HIS 36.A ND1 TYR 321.A OH no hydrogen 2.854 N/A HIS 36.A NE2 THR 217.A OG1 no hydrogen 2.917 N/A ALA 38.A N ASP 34.A O no hydrogen 2.921 N/A GLY 39.A N SER 35.A O.A no hydrogen 3.149 N/A GLY 39.A N SER 35.A O.B no hydrogen 3.167 N/A ASP 40.A N THR 37.A O no hydrogen 3.115 N/A THR 43.A OG1 ASP 40.A OD1 no hydrogen 2.408 N/A ASP 44.A N ASP 40.A O no hydrogen 2.887 N/A SER 45.A N PHE 41.A O no hydrogen 3.390 N/A SER 45.A OG ARG 322.A O no hydrogen 3.347 N/A LEU 46.A N PHE 42.A O no hydrogen 3.149 N/A ARG 47.A N THR 43.A O no hydrogen 2.835 N/A ARG 47.A NH1 VAL 181.A O no hydrogen 2.699 N/A ARG 47.A NH2 ASP 40.A OD1 no hydrogen 2.804 N/A ARG 47.A NH2 ASP 40.A OD2 no hydrogen 2.636 N/A ARG 47.A NH2 ASP 44.A OD1 no hydrogen 3.475 N/A LYS 48.A N ASP 44.A O no hydrogen 2.815 N/A ARG 49.A N SER 45.A O no hydrogen 3.061 N/A ARG 49.A NE GLU 332.A OE2 no hydrogen 2.954 N/A ARG 49.A NH1 ASP 329.A OD1 no hydrogen 3.501 N/A ARG 49.A NH2 ASP 329.A OD1 no hydrogen 2.741 N/A ARG 49.A NH2 GLU 332.A OE1 no hydrogen 3.444 N/A LEU 50.A N LEU 46.A O no hydrogen 2.941 N/A GLN 51.A N ARG 47.A O no hydrogen 2.888 N/A GLN 51.A NE2 GLY 58.A O no hydrogen 3.045 N/A GLN 51.A NE2 ILE 179.A O no hydrogen 2.778 N/A LYS 52.A N LYS 48.A O no hydrogen 3.287 N/A THR 53.A N ARG 49.A O no hydrogen 3.082 N/A THR 53.A OG1 ARG 49.A O no hydrogen 3.104 N/A THR 53.A OG1 GLU 332.A OE2 no hydrogen 2.943 N/A TRP 54.A N LEU 50.A O no hydrogen 2.881 N/A GLY 55.A N GLN 51.A O no hydrogen 2.802 N/A GLY 57.A N GLY 55.A O no hydrogen 3.068 N/A GLY 57.A N ILE 179.A O no hydrogen 2.888 N/A GLY 58.A N ASP 56.A OD1 no hydrogen 3.027 N/A GLY 60.A N ILE 172.A O no hydrogen 2.857 N/A TRP 61.A N SER 182.A OG no hydrogen 2.927 N/A TRP 61.A NE1 THR 206.A O no hydrogen 3.276 N/A VAL 62.A N ILE 170.A O no hydrogen 2.781 N/A GLN 70.A N VAL 67.A O no hydrogen 3.104 N/A GLN 70.A NE2 TYR 63.A OH no hydrogen 3.035 N/A GLN 70.A NE2 GLY 184.A O no hydrogen 2.943 N/A ARG 71.A N ALA 38.A O no hydrogen 3.038 N/A ARG 71.A NH1 GLY 39.A O no hydrogen 3.122 N/A ARG 75.A N THR 109.A O no hydrogen 2.961 N/A HIS 76.A NE2 TYR 63.A O no hydrogen 2.834 N/A ASN 77.A N THR 107.A O no hydrogen 2.967 N/A ASN 79.A N SER 106.A O no hydrogen 2.893 N/A ASN 79.A ND2 GLY 104.A O no hydrogen 3.622 N/A GLN 81.A N HIS 100.A O no hydrogen 2.873 N/A GLN 81.A NE2 SER 82.A O no hydrogen 3.246 N/A SER 82.A OG ASN 66.A O no hydrogen 2.693 N/A LEU 83.A N LEU 98.A O no hydrogen 2.632 N/A THR 84.A OG1 GLY 96.A O no hydrogen 3.443 N/A SER 85.A N GLY 96.A O no hydrogen 2.921 N/A LEU 94.A N ASP 202.A OD2 no hydrogen 3.150 N/A GLY 96.A N PRO 93.A O no hydrogen 3.267 N/A LEU 98.A N LEU 83.A O no hydrogen 3.004 N/A ALA 99.A N ILE 167.A O no hydrogen 2.990 N/A HIS 100.A N GLN 81.A O no hydrogen 2.941 N/A HIS 100.A ND1 ASP 166.A OD1 no hydrogen 2.557 N/A THR 101.A N TRP 165.A O no hydrogen 3.045 N/A THR 101.A OG1 GLY 102.A O no hydrogen 3.398 N/A THR 101.A OG1 TRP 165.A O no hydrogen 3.139 N/A GLY 104.A N GLU 163.A O no hydrogen 3.158 N/A SER 106.A N ASN 79.A OD1 no hydrogen 2.695 N/A SER 106.A OG HIS 161.A ND1 no hydrogen 3.334 N/A LEU 108.A N LEU 158.A O no hydrogen 2.959 N/A THR 109.A N ARG 75.A O no hydrogen 3.032 N/A SER 111.A N ALA 73.A O no hydrogen 3.519 N/A SER 111.A OG ALA 72.A O no hydrogen 3.280 N/A SER 116.A N ILE 114.A O no hydrogen 2.590 N/A GLN 118.A N ALA 154.A O no hydrogen 2.516 N/A ARG 119.A N GLU 173.A O no hydrogen 2.972 N/A ARG 119.A NE GLU 173.A OE1 no hydrogen 3.317 N/A ARG 119.A NH2 THR 26.A OG1 no hydrogen 2.674 N/A ARG 119.A NH2 GLU 173.A OE1 no hydrogen 2.995 N/A VAL 120.A N THR 152.A O no hydrogen 3.159 N/A SER 121.A N ASN 171.A O no hydrogen 2.985 N/A SER 121.A OG ASP 151.A OD1 no hydrogen 2.603 N/A LEU 122.A N LEU 150.A O no hydrogen 2.994 N/A PHE 123.A N PHE 169.A O no hydrogen 3.000 N/A ALA 124.A N GLN 148.A O no hydrogen 2.810 N/A LYS 125.A N ASP 166.A O no hydrogen 2.794 N/A LYS 125.A NZ ASP 91.A OD2 no hydrogen 2.600 N/A LEU 127.A N PRO 164.A O no hydrogen 3.261 N/A LEU 128.A N GLN 131.A OE1 no hydrogen 2.923 N/A GLN 131.A N LEU 128.A O no hydrogen 3.330 N/A GLN 131.A NE2 PRO 164.A O no hydrogen 2.947 N/A LEU 133.A N VAL 140.A O no hydrogen 3.069 N/A THR 134.A N HIS 161.A O no hydrogen 3.123 N/A VAL 135.A N ASN 138.A O no hydrogen 2.902 N/A ASN 136.A N THR 159.A O no hydrogen 2.918 N/A ASN 136.A ND2 ALA 155.A O no hydrogen 3.364 N/A ASN 136.A ND2 PRO 157.A O no hydrogen 3.576 N/A ASN 138.A N VAL 135.A O no hydrogen 3.059 N/A VAL 140.A N LEU 133.A O no hydrogen 2.841 N/A ALA 142.A N GLN 131.A O no hydrogen 3.083 N/A ASN 143.A N GLN 148.A OE1 no hydrogen 2.933 N/A GLY 144.A N GLU 130.A OE1 no hydrogen 3.169 N/A GLN 148.A N ALA 124.A O no hydrogen 2.925 N/A GLN 148.A NE2 ASN 143.A O no hydrogen 3.217 N/A GLN 148.A NE2 GLY 144.A O no hydrogen 3.536 N/A GLN 148.A NE2 GLY 146.A O no hydrogen 3.175 N/A LEU 150.A N LEU 122.A O no hydrogen 2.818 N/A THR 152.A N VAL 120.A O no hydrogen 2.738 N/A GLY 153.A N THR 152.A OG1 no hydrogen 2.637 N/A ALA 154.A N GLN 118.A O no hydrogen 2.933 N/A LEU 158.A N LEU 108.A O no hydrogen 2.995 N/A THR 159.A N ASN 136.A OD1 no hydrogen 2.952 N/A HIS 161.A N THR 134.A O no hydrogen 3.071 N/A THR 162.A N GLY 105.A O no hydrogen 2.821 N/A TRP 165.A N THR 101.A OG1 no hydrogen 2.963 N/A TRP 165.A NE1 THR 132.A O no hydrogen 2.941 N/A ASP 166.A N LYS 125.A O no hydrogen 2.759 N/A ILE 167.A N ALA 99.A O no hydrogen 2.940 N/A GLY 168.A N PHE 123.A O no hydrogen 2.799 N/A ILE 170.A N VAL 62.A O no hydrogen 2.914 N/A ASN 171.A N SER 121.A O no hydrogen 2.542 N/A ILE 172.A N GLY 60.A O no hydrogen 2.992 N/A GLU 173.A N ARG 119.A O no hydrogen 2.993 N/A ASN 174.A N GLY 57.A O no hydrogen 2.863 N/A ALA 176.A N ASN 174.A OD1 no hydrogen 2.680 N/A GLY 177.A N ASN 174.A O no hydrogen 3.198 N/A GLY 178.A N GLU 25.A O no hydrogen 2.653 N/A ILE 179.A N GLY 55.A O no hydrogen 2.787 N/A THR 180.A N PHE 27.A O no hydrogen 3.098 N/A SER 182.A N ILE 29.A O no hydrogen 2.614 N/A ILE 185.A N GLY 33.A O no hydrogen 2.992 N/A ASN 186.A N GLN 70.A OE1 no hydrogen 3.028 N/A ASN 186.A ND2 GLY 69.A O no hydrogen 2.869 N/A GLY 187.A N SER 35.A OG.B no hydrogen 2.831 N/A ALA 188.A N ILE 185.A O no hydrogen 3.172 N/A GLN 189.A N GLN 192.A OE1 no hydrogen 2.627 N/A LEU 190.A N GLU 219.A OE2 no hydrogen 2.902 N/A GLN 192.A N GLN 189.A O no hydrogen 2.989 N/A TRP 193.A N LEU 190.A O no hydrogen 3.303 N/A TRP 193.A NE1 TYR 215.A OH no hydrogen 2.876 N/A SER 194.A N THR 191.A O no hydrogen 3.354 N/A SER 194.A OG THR 191.A O no hydrogen 3.398 N/A LYS 195.A N GLN 192.A O no hydrogen 3.317 N/A LYS 195.A NZ SER 85.A O no hydrogen 3.156 N/A TRP 196.A N TRP 193.A O no hydrogen 2.969 N/A TRP 196.A NE1 SER 85.A OG no hydrogen 3.041 N/A ARG 197.A N PHE 92.A O no hydrogen 2.733 N/A ARG 197.A NE ASP 202.A OD2 no hydrogen 2.945 N/A ARG 197.A NH2 ASP 202.A OD1 no hydrogen 2.861 N/A ARG 197.A NH2 ASP 202.A OD2 no hydrogen 3.475 N/A ARG 200.A N ARG 197.A O no hydrogen 3.026 N/A ARG 200.A NH1 ARG 197.A O no hydrogen 3.253 N/A ASP 202.A N ASP 199.A O no hydrogen 3.062 N/A LEU 203.A N ARG 200.A O no hydrogen 2.831 N/A GLN 205.A N ASN 201.A O no hydrogen 3.223 N/A GLN 205.A N ASP 202.A O no hydrogen 2.804 N/A THR 206.A N ASP 202.A O no hydrogen 3.163 N/A THR 206.A N LEU 203.A O no hydrogen 3.068 N/A THR 206.A OG1 LEU 203.A O no hydrogen 2.694 N/A ALA 208.A N THR 206.A OG1 no hydrogen 3.298 N/A ASP 209.A N ARG 28.A O no hydrogen 2.880 N/A LEU 210.A N ARG 28.A O no hydrogen 3.147 N/A VAL 211.A N GLY 249.A O no hydrogen 2.741 N/A ILE 212.A N LEU 30.A O no hydrogen 2.874 N/A LEU 213.A N LEU 251.A O no hydrogen 2.831 N/A SER 214.A N ILE 32.A O no hydrogen 3.013 N/A GLY 216.A N GLU 219.A OE1 no hydrogen 2.854 N/A THR 217.A OG1 HIS 36.A NE2 no hydrogen 2.917 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.902 N/A ALA 220.A N GLY 216.A O no hydrogen 2.888 N/A PHE 221.A N ASN 218.A O no hydrogen 3.164 N/A ASN 222.A N GLU 219.A O no hydrogen 2.967 N/A ASN 224.A N ASN 222.A OD1 no hydrogen 3.046 N/A ILE 225.A N ASN 222.A O no hydrogen 3.085 N/A ASP 229.A N ASP 226.A OD1 no hydrogen 3.027 N/A THR 230.A N ASP 226.A O no hydrogen 2.854 N/A THR 230.A OG1 ASP 226.A O no hydrogen 2.752 N/A GLU 231.A N ILE 227.A O no hydrogen 2.755 N/A GLN 232.A N ALA 228.A O no hydrogen 3.316 N/A LYS 233.A N ASP 229.A O no hydrogen 3.334 N/A TRP 234.A N THR 230.A O no hydrogen 2.877 N/A LEU 235.A N GLU 231.A O no hydrogen 2.845 N/A ASP 236.A N GLN 232.A O no hydrogen 2.708 N/A THR 237.A N LYS 233.A O no hydrogen 2.819 N/A THR 237.A OG1 LYS 233.A O no hydrogen 2.551 N/A VAL 238.A N TRP 234.A O no hydrogen 2.939 N/A ARG 239.A N LEU 235.A O no hydrogen 2.952 N/A ARG 239.A NH2 ASP 236.A OD1 no hydrogen 2.917 N/A GLN 240.A N ASP 236.A O no hydrogen 2.968 N/A ILE 241.A N THR 237.A O no hydrogen 3.070 N/A ARG 242.A N VAL 238.A O no hydrogen 3.082 N/A ARG 242.A NE GLY 286.A O no hydrogen 3.257 N/A ARG 242.A NH2 GLY 286.A O no hydrogen 2.721 N/A ASP 243.A N ARG 239.A O no hydrogen 2.890 N/A SER 244.A N GLN 240.A O no hydrogen 2.926 N/A SER 244.A OG GLN 240.A O no hydrogen 3.389 N/A LEU 245.A N ILE 241.A O no hydrogen 2.793 N/A ALA 248.A N LEU 245.A O no hydrogen 3.037 N/A GLY 249.A N ASP 209.A O no hydrogen 2.667 N/A LEU 251.A N VAL 211.A O no hydrogen 2.762 N/A ILE 253.A N LEU 213.A O no hydrogen 2.985 N/A GLY 254.A N TRP 290.A O no hydrogen 2.963 N/A ALA 255.A N GLN 279.A OE1 no hydrogen 2.806 N/A LEU 259.A N GLY 313.A O no hydrogen 3.042 N/A LYS 260.A N THR 268.A O no hydrogen 2.512 N/A ASN 261.A N THR 268.A O no hydrogen 3.438 N/A LEU 263.A N GLY 267.A O no hydrogen 2.996 N/A CYS 266.A SG GLU 257.A OE1 no hydrogen 3.065 N/A THR 268.A N ASN 261.A O no hydrogen 2.735 N/A ARG 269.A NH1 GLU 257.A OE2 no hydrogen 2.688 N/A ARG 269.A NH1 GLN 293.A OE1 no hydrogen 2.745 N/A ARG 269.A NH2 THR 274.A OG1 no hydrogen 2.827 N/A ARG 269.A NH2 GLN 277.A OE1 no hydrogen 2.991 N/A ARG 272.A NE GLU 275.A OE2 no hydrogen 2.447 N/A ARG 272.A NH1 ASN 223.A O no hydrogen 3.163 N/A ARG 272.A NH1 ILE 225.A O no hydrogen 3.074 N/A ARG 272.A NH2 ILE 225.A O no hydrogen 3.475 N/A ARG 272.A NH2 GLU 275.A OE1 no hydrogen 2.687 N/A LEU 273.A N PRO 270.A O no hydrogen 3.022 N/A VAL 276.A N ARG 272.A O no hydrogen 3.159 N/A GLN 277.A N LEU 273.A O no hydrogen 2.896 N/A GLN 277.A NE2 ALA 255.A O no hydrogen 2.819 N/A GLN 277.A NE2 GLN 293.A OE1 no hydrogen 2.925 N/A GLN 278.A N THR 274.A O no hydrogen 2.891 N/A GLN 279.A NE2 TYR 215.A O no hydrogen 2.914 N/A GLN 279.A NE2 ILE 253.A O no hydrogen 3.546 N/A ARG 280.A N GLN 277.A O no hydrogen 3.341 N/A ARG 280.A NH1 TYR 5.A OH no hydrogen 2.674 N/A ARG 281.A N GLN 278.A O no hydrogen 3.209 N/A ARG 281.A NE GLU 231.A OE1 no hydrogen 3.203 N/A ARG 281.A NE GLU 231.A OE2 no hydrogen 3.235 N/A ARG 281.A NH2 GLU 231.A OE1 no hydrogen 2.883 N/A ALA 283.A N GLN 279.A O no hydrogen 2.985 N/A ARG 284.A N ARG 280.A O no hydrogen 2.952 N/A GLN 285.A N ARG 281.A O no hydrogen 2.976 N/A GLY 286.A N VAL 282.A O no hydrogen 2.812 N/A GLN 287.A N ARG 284.A O no hydrogen 3.145 N/A THR 288.A N ALA 283.A O no hydrogen 2.716 N/A THR 288.A OG1 ILE 250.A O no hydrogen 3.296 N/A TRP 290.A N ILE 252.A O no hydrogen 2.892 N/A SER 291.A N LEU 1.A O no hydrogen 2.962 N/A ASN 294.A N SER 291.A OG no hydrogen 2.985 N/A ALA 295.A N SER 291.A O no hydrogen 2.944 N/A GLY 297.A N GLN 293.A O no hydrogen 2.954 N/A CYS 299.A N GLU 257.A OE2 no hydrogen 2.936 N/A CYS 299.A SG VAL 265.A O no hydrogen 3.166 N/A SER 300.A N GLU 257.A OE1 no hydrogen 2.751 N/A SER 300.A OG GLY 297.A O no hydrogen 2.832 N/A LYS 301.A NZ THR 262.A O no hydrogen 3.421 N/A TRP 303.A N SER 300.A O no hydrogen 2.873 N/A ASN 305.A N LYS 301.A O no hydrogen 2.668 N/A GLN 306.A N TRP 303.A O no hydrogen 3.229 N/A GLY 307.A N LEU 304.A O no hydrogen 3.216 N/A TRP 308.A N TRP 303.A O no hydrogen 2.788 N/A ALA 310.A N HIS 315.A O no hydrogen 2.686 N/A GLY 313.A N ALA 310.A O no hydrogen 3.215 N/A VAL 314.A N ASP 312.A OD1 no hydrogen 2.670 N/A HIS 315.A N ASP 312.A OD1 no hydrogen 2.951 N/A HIS 315.A ND1 ASP 312.A OD2 no hydrogen 2.529 N/A PHE 316.A N TYR 321.A OH no hydrogen 3.150 N/A SER 317.A N TRP 308.A O no hydrogen 3.082 N/A SER 317.A OG GLY 307.A O no hydrogen 2.693 N/A GLY 320.A N SER 317.A OG no hydrogen 3.143 N/A TYR 321.A N SER 317.A O no hydrogen 2.961 N/A TYR 321.A OH HIS 36.A ND1 no hydrogen 2.854 N/A ARG 322.A N ALA 318.A O no hydrogen 3.062 N/A ARG 323.A N LYS 319.A O no hydrogen 3.019 N/A ALA 324.A N GLY 320.A O no hydrogen 3.031 N/A ALA 325.A N TYR 321.A O no hydrogen 2.825 N/A GLU 326.A N ARG 322.A O no hydrogen 3.123 N/A ALA 328.A N ALA 325.A O no hydrogen 2.831 N/A ASP 329.A N GLU 326.A O no hydrogen 2.872 N/A LEU 331.A N LEU 327.A O no hydrogen 2.893 N/A GLU 332.A N ALA 328.A O no hydrogen 2.876 N/A GLU 333.A N ASP 329.A O no hydrogen 2.883 N/A LEU 334.A N SER 330.A O no hydrogen 2.873 N/A VAL 335.A N LEU 331.A O no hydrogen 3.102 N/A ARG 336.A N GLU 332.A O no hydrogen 2.772 N/A ARG 336.A NH2 GLU 333.A OE2 no hydrogen 2.788 N/A SER 337.A N GLU 333.A O no hydrogen 3.118 N/A SER 337.A N LEU 334.A O no hydrogen 3.098 N/A SER 337.A OG LEU 334.A O no hydrogen 3.464 N/A ALA 338.A N VAL 335.A O no hydrogen 2.973 N/A